5-butoxy-2-[2-(4-pentylphenyl)ethynyl]pyridine

Systemtic Name: 5-butoxy-2-[2-(4-pentylphenyl)ethynyl]pyridine Openeye Name: 5-butoxy-2-[2-(4-pentylphenyl)ethynyl]pyridine CAS Name: 5-butoxy-2-[2-(4-pentylphenyl)ethynyl]pyridine IUPAC Name: 5-butoxy-2-[2-(4-pentylphenyl)ethynyl]pyridine Traditional Name: 2-[2-(4-amylphenyl)ethynyl]-5-butoxy-pyridine Formula: C22H27NO MolecularWeight: 321.45588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C#CC2=NC=C(C=C2)OCCCC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C#CC2=NC=C(C=C2)OCCCC

InChI

InChI=1S/C22H27NO/c1-3-5-7-8-19-9-11-20(12-10-19)13-14-21-15-16-22(18-23-21)24-17-6-4-2/h9-12,15-16,18H,3-8,17H2,1-2H3